Geometry & MOs

Info

ID:	3798
PubChem CID:	10221
Reduced:	O3H8C11 (1)
Stoich.:	A3B8C11 (1)
Weight, g/mol:	188.047344
ΔH_f, kcal/mol:	-67.68
Dipole, Da:	5.6
IP(EA), eV:	-9.64(-1.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-hydroxy-3-methylnaphthalene-1,2-dione

Drug info:

PubChemData

Smile

CC1=C(C2=CC=CC=C2C(=O)C1=O)O

DOS

IR

Vibrations